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Molecule record

1-chloro-3-ethylbenzene

C8H9Cl

140.61 g/mol

Loading structure

Molecular properties

Formula
C8H9Cl
Molar mass
140.61 g·mol−1
Exact mass
140.0393 Da
4
PubChem CID
136426

Functional groups

Alkane / alkyl carbon
Aromatic ring
Aryl halide

Physical properties

No source-backed physical properties are curated for this molecule yet.

Common names and synonyms

  • 1-chloro-3-ethyl-benzene
  • 3-CHLORO-ETHYLBENZENE
  • 3-Ethylchlorobenzene
  • 3-chloroethylbenzene
  • 620-16-6
  • 961-319-7
  • A928542
  • AR4N74Z5NU
Show all 24 synonyms
  • AS-30445
  • Benzene, 1-chloro-3-ethyl-
  • CS-0168176
  • DTXCID40133523
  • DTXSID40211032
  • FT-0703003
  • LOXUEGMPESDGBQ-UHFFFAOYSA-N
  • MFCD02181081
  • NSC 60919
  • NSC60919
  • RefChem:75381
  • SCHEMBL129094
  • SCHEMBL455325
  • SCHEMBL455459
  • SCHEMBL91280
  • m-Chloroethylbenzene

Structure identifiers

Canonical SMILES
CCc1cccc(Cl)c1
Isomeric SMILES
CCC1=CC(=CC=C1)Cl
InChI
InChI=1S/C8H9Cl/c1-2-7-4-3-5-8(9)6-7/h3-6H,2H2,1H3
InChIKey
LOXUEGMPESDGBQ-UHFFFAOYSA-N
PubChem CID
136426

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library
No redistributable or simulated spectroscopy record is attached yet.

Simulated NMR

On-demand educational prediction for 1-chloro-3-ethylbenzene; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 1-chloro-3-ethylbenzene; not experimental data.

Sources

Molecule identity

Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.

PubChem(link only)
Open source record